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8-Hydroxy-5-(6-methyl-1,1-dioxido-1,2,6-thiadiazinan-2-yl)-1,6-naphthyridine-7-carboxylic acid

HCID 59645252
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN1CCCN(c2nc(C(=O)O)c(O)c3ncccc23)S1(=O)=O
InChIKey
HJVXPDFDJZYBND-UHFFFAOYSA-N
Molecular formula
C13H14N4O5S
Average molar mass
338.34 g/mol

Names & identifiers

Preferred name
8-Hydroxy-5-(6-methyl-1,1-dioxido-1,2,6-thiadiazinan-2-yl)-1,6-naphthyridine-7-carboxylic acid
IUPAC
8-hydroxy-5-(6-methyl-1,1-dioxo-1,2,6-thiadiazinan-2-yl)-1,6-naphthyridine-7-carboxylic acid

Names & synonyms

SCHEMBL4764998HJVXPDFDJZYBND-UHFFFAOYSA-N8-Hydroxy-5-(6-methyl-1,1-dioxido-1,2,6-thiadiazinan-2-yl)-1,6-naphthyridine-7-carboxylic acid

Database identifiers

PubChem CID
59645252

Properties

Computed structural properties

XLogP
0.7
Topological polar surface area
132 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
2
Heavy atoms
23
Formal charge
0
Complexity
565

Related reactions

4 records
New reaction record
HRID 1536121 reaction equation
HRID 1536121As productTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 2252824 reaction equation
HRID 2252824As productuspto-grants-2008_01
HRID 2252825 reaction equation
HRID 2252825As reactantuspto-grants-2008_01
HRID 2322408 reaction equation
HRID 2322408As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes